Ulrike Salzner
Ulrike Salzner
Verified email at fen.bilkent.edu.tr
Title
Cited by
Cited by
Year
Tuned range-separated hybrids in density functional theory
R Baer, E Livshits, U Salzner
Annual review of physical chemistry 61, 85-109, 2010
5372010
Comparison of geometries and electronic structures of polyacetylene, polyborole, polycyclopentadiene, polypyrrole, polyfuran, polysilole, polyphosphole, polythiophene …
U Salzner, JB Lagowski, PG Pickup, RA Poirier
Synthetic Metals 96 (3), 177-189, 1998
4361998
Ab initio examination of anomeric effects in tetrahydropyrans, 1, 3-dioxanes, and glucose
U Salzner, PR Schleyer
The Journal of Organic Chemistry 59 (8), 2138-2155, 1994
2551994
Generalized anomeric effects and hyperconjugation in CH2 (OH) 2, CH2 (SH) 2, CH2 (SeH) 2, and CH2 (TeH) 2
U Salzner, PR Schleyer
Journal of the American Chemical Society 115 (22), 10231-10236, 1993
2171993
Accurate method for obtaining band gaps in conducting polymers using a DFT/hybrid approach
U Salzner, PG Pickup, RA Poirier, JB Lagowski
The Journal of Physical Chemistry A 102 (15), 2572-2578, 1998
1811998
Koopmans’ springs to life
U Salzner, R Baer
The Journal of chemical physics 131 (23), 231101, 2009
1752009
Design of low band gap polymers employing density functional theory—hybrid functionals ameliorate band gap problem
U Salzner, JB Lagowski, PG Pickup, RA Poirier
Journal of computational chemistry 18 (15), 1943-1953, 1997
1741997
Improved prediction of properties of π-conjugated oligomers with range-separated hybrid density functionals
U Salzner, A Aydin
Journal of chemical theory and computation 7 (8), 2568-2583, 2011
1372011
Does the donor–acceptor concept work for designing synthetic metals?
U Salzner, O Karaltı, S Durdaği
Journal of molecular modeling 12 (5), 687-701, 2006
130*2006
Does the Donor− Acceptor Concept Work for Designing Synthetic Metals? 1. Theoretical Investigation of Poly (3-cyano-3 ‘-hydroxybithiophene)
U Salzner
The Journal of Physical Chemistry B 106 (36), 9214-9220, 2002
822002
Origin of the anomeric effect revisited. Theoretical conformation analysis of 2-hydroxypiperidine and 2-hydroxyhexahydropyrimidine
U Salzner
The Journal of Organic Chemistry 60 (4), 986-995, 1995
691995
Electronic structure of conducting organic polymers: insights from time‐dependent density functional theory
U Salzner
Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (6), 601-622, 2014
682014
Conducting copolymers of pyridine with thiophene, N-methylpyrrole, and selenophene
IH Jenkins, U Salzner, PG Pickup
Chemistry of materials 8 (10), 2444-2450, 1996
621996
Theoretical investigation of excited states of oligothiophenes and of their monocations
U Salzner
Journal of chemical theory and computation 3 (3), 1143-1157, 2007
552007
Investigation of charge carriers in doped thiophene oligomers through theoretical modeling of their UV/Vis spectra
U Salzner
The Journal of Physical Chemistry A 112 (24), 5458-5466, 2008
542008
Theoretical design of conjugated organic polymers
U Salzner
Current Organic Chemistry 8 (7), 569-590, 2004
482004
Nature of charge carriers in long doped oligothiophenes: the effect of counterions
N Zamoshchik, U Salzner, M Bendikov
The Journal of Physical Chemistry C 112 (22), 8408-8418, 2008
432008
Use of side-chain for rational design of n-type diketopyrrolopyrrole-based conjugated polymers: what did we find out?
C Kanimozhi, N Yaacobi-Gross, EK Burnett, AL Briseno, TD Anthopoulos, ...
Physical Chemistry Chemical Physics 16 (32), 17253-17265, 2014
412014
Quantitatively correct UV-vis spectrum of ferrocene with TDB3LYP
U Salzner
Journal of Chemical Theory and Computation 9 (9), 4064-4073, 2013
402013
Ab initio studies of the geometries and electronic structures of CaF2 and CaCl2
U Salzner, P von Ragué Schleyer
Chemical physics letters 172 (6), 461-470, 1990
351990
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Articles 1–20